2,6-bis(azanyl)-4-(2,4,6-trimethyl-3,5-dinitro-phenyl)-4H-thiopyran-3,5-dicarbonitrile

Systemtic Name: 2,6-bis(azanyl)-4-(2,4,6-trimethyl-3,5-dinitro-phenyl)-4H-thiopyran-3,5-dicarbonitrile Openeye Name: 2,6-diamino-4-(2,4,6-trimethyl-3,5-dinitro-phenyl)-4H-thiopyran-3,5-dicarbonitrile CAS Name: 2,6-diamino-4-(2,4,6-trimethyl-3,5-dinitrophenyl)-4H-thiopyran-3,5-dicarbonitrile IUPAC Name: 2,6-diamino-4-(2,4,6-trimethyl-3,5-dinitrophenyl)-4H-thiopyran-3,5-dicarbonitrile Traditional Name: 2,6-diamino-4-(2,4,6-trimethyl-3,5-dinitro-phenyl)-4H-thiopyran-3,5-dicarbonitrile Formula: C16H14N6O4S MolecularWeight: 386.38516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1[N+](=O)[O-])C)[N+](=O)[O-])C)C2C(=C(SC(=C2C#N)N)N)C#N

Isomeric SMILES

CC1=C(C(=C(C(=C1[N+](=O)[O-])C)[N+](=O)[O-])C)C2C(=C(SC(=C2C#N)N)N)C#N

InChI

InChI=1S/C16H14N6O4S/c1-6-11(7(2)14(22(25)26)8(3)13(6)21(23)24)12-9(4-17)15(19)27-16(20)10(12)5-18/h12H,19-20H2,1-3H3